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[(2R,3R,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

Base Information
  • Chemical Name:[(2R,3R,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
  • CAS No.:110326-99-3
  • Molecular Formula:C29H36 O14
  • Molecular Weight:608.5877
  • Hs Code.:
  • DSSTox Substance ID:DTXSID801347710
  • Wikidata:Q110183806
[(2R,3R,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

Synonyms:110326-99-3;[(2R,3R,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate;lipedoside A;Lipedoside A I;DTXSID801347710;beta-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl3-O-(6-deoxy-alpha-L-mannopyranosyl)-, 4-(3-(4-hydroxyphenyl)-2-propenoate), (E)-

Suppliers and Price of [(2R,3R,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
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Chemical Property of [(2R,3R,4S,5R,6R)-5-(3,4-dihydroxyphenyl)-6-ethoxy-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Chemical Property:
  • Vapor Pressure:2.95E-32mmHg at 25°C 
  • Boiling Point:869.1°Cat760mmHg 
  • PKA:9.67±0.26(Predicted) 
  • Flash Point:282.2°C 
  • PSA:225.06000 
  • Density:1.55g/cm3 
  • LogP:-0.41740 
  • XLogP3:-0.5
  • Hydrogen Bond Donor Count:8
  • Hydrogen Bond Acceptor Count:14
  • Rotatable Bond Count:10
  • Exact Mass:608.21050582
  • Heavy Atom Count:43
  • Complexity:927
Purity/Quality:
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCOC1C(C(C(C(O1)CO)OC(=O)C=CC2=CC=C(C=C2)O)OC3C(C(C(C(O3)C)O)O)O)(C4=CC(=C(C=C4)O)O)O
  • Isomeric SMILES:CCO[C@H]1[C@]([C@H]([C@@H]([C@H](O1)CO)OC(=O)/C=C/C2=CC=C(C=C2)O)O[C@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)C)O)O)O)(C4=CC(=C(C=C4)O)O)O
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